SCHEMBL29393259

SCHEMBL29393259

Cc1cc(C(N)=NO)cnc1CO

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.36
GFER P55789 1/20 0.36
KMT2A Q03164 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
GAA P10253 3/20 0.35
RAB9A P51151 2/20 0.35
RECQL P46063 1/20 0.35
MAPT P10636 2/20 0.33
NPC1 O15118 1/20 0.33
TP53 P04637 1/20 0.33
ALOX15 P16050 1/20 0.33
HSD17B10 Q99714 1/20 0.33
NPSR1 Q6W5P4 1/20 0.32
AGBL2 Q5U5Z8 2/20 0.32
AGXT P21549 1/20 0.32
DPP4 P27487 1/20 0.31
CHRNB2 P17787 1/20 0.30
CHRNB4 P30926 1/20 0.30
CHRNA3 P32297 1/20 0.30
CHRNA4 P43681 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL25231695 1.00 LMNA (0.36) LMNAGFERKMT2AL3MBTL1GAA
SCHEMBL25241798 0.79 LMNA (0.40) LMNAGFERKMT2AL3MBTL1GAA
SCHEMBL29392876 0.79 LMNA (0.40) LMNAGFERKMT2AL3MBTL1GAA
SCHEMBL1727070 0.77 NOS3 (0.48) LMNAGFERKMT2AL3MBTL1GAA
SCHEMBL1727072 0.77 NOS3 (0.48) LMNAGFERKMT2AL3MBTL1GAA
SCHEMBL3463153 0.77 RECQL (0.41) LMNAGFERKMT2AL3MBTL1GAA
SCHEMBL3463152 0.77 RECQL (0.41) LMNAGFERKMT2AL3MBTL1GAA
SCHEMBL15350918 0.74 HCAR2 (0.48) KMT2AL3MBTL1GAAMAPTALOX15
SCHEMBL20330407 0.71 ATM (0.54) LMNAGFERL3MBTL1GAAMAPT
SCHEMBL22557330 0.71 NOS3 (0.40) AGBL2AGXTDPP4

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4192831-A1 HETEROCYCLIC GLP-1 AGONISTS Gasherbrum Bio, Inc. (US) 2023-06-14 EP disclosed
WO-2022028572-A1 HETEROCYCLIC GLP-1 AGONISTS GASHERBRUM BIO, INC. (US) 2022-02-10 WO disclosed